Acetone-2-13C,d6
IUPAC: 1,1,1,3,3,3-hexadeuterio(213C)propan-2-one
Plain text
Chemfused. (2026). Acetone-2-13C,d6, CAS 32479-94-0. Retrieved 2026-04-28 from https://chemfused.com/cas/32479-94-0
BibTeX
@misc{chemfused-cas-32479940,
title = {Acetone-2-13C,d6, CAS 32479-94-0},
author = {Chemfused},
year = {2026},
url = {https://chemfused.com/cas/32479-94-0},
urldate = {2026-04-28}
}
Acetone-2-13C,d6 (CAS 32479-94-0) is a chemical compound with molecular formula C3H6O and molecular weight 65.11 g/mol . GHS signal word: Danger. Hazard classifications: Flammable, Health Hazard.
What is Acetone-2-13C,d6?
- Molecular Formula
- C3H6O
- Molecular Weight
- 65.11 g/mol
Structure Identifiers
- SMILES
- [2H]C([2H])([2H])[13C](=O)C([2H])([2H])[2H]
- InChI
- InChI=1S/C3H6O/c1-3(2)4/h1-2H3/i1D3,2D3,3+1
- InChIKey
- CSCPPACGZOOCGX-ILPQSMFLSA-N
Properties
Computed
Calculated molecular descriptors used in drug design and computational chemistry.
- Exact Mass
- 65.0829 Da
- XLogP
- -0.10
- TPSA
- 17.1 Ų
- H-Bond Donors
- 0
- H-Bond Acceptors
- 1
- Complexity
- 26
- Formal Charge
- 0
Safety information
Signal Word
GHS Pictograms
GHS02
GHS07
Hazard Statements
- H225 Highly flammable liquid and vapour
Precautionary Statements
- P210 Keep away from heat/sparks/open flames/hot surfaces - No smoking
- P233 Keep container tightly closed
- P240 Ground/bond container and receiving equipment
- P241 Use explosion-proof electrical/ventilating/lighting equipment
- P242 Use only non-sparking tools
- P243 Take precautionary measures against static discharge
- P261 Avoid breathing dust/fume/gas/mist/vapours/spray
- P271 Use only outdoors or in a well-ventilated area
- P280 Wear protective gloves/protective clothing/eye protection/face protection
- P303+P361+P353 IF ON SKIN (or hair): Remove/Take off immediately all contaminated clothing. Rinse skin with water/shower
- P304+P340 IF INHALED: Remove victim to fresh air and keep at rest in a position comfortable for breathing
- P305+P351+P338 IF IN EYES: Rinse continuously with water for several minutes. Remove contact lenses if present and easy to do, continue rinsing
- P370+P378 In case of fire: Use appropriate media for extinction
- P403+P233 Store in a well-ventilated place. Keep container tightly closed
- P403+P235 Store in a well-ventilated place. Keep cool
- P405 Store locked up
- P501 Dispose of contents/container to an approved waste disposal plant
Synonyms (5)
- 686-129-9
- 32479-94-0
- RefChem:552396
- Acetone-2-13C,d6
- Acetone-2-13C,d6, 98 atom % D, 99 atom % 13C
Frequently asked questions
What is the CAS number of Acetone-2-13C,d6?
The CAS Registry Number for Acetone-2-13C,d6 is 32479-94-0.
What is the IUPAC name of Acetone-2-13C,d6?
The IUPAC name of Acetone-2-13C,d6 is 1,1,1,3,3,3-hexadeuterio(213C)propan-2-one.
What is the molecular formula of Acetone-2-13C,d6?
Acetone-2-13C,d6 has the molecular formula C3H6O and a molecular weight of 65.11 g/mol.
What is the SMILES notation for Acetone-2-13C,d6?
The SMILES notation for Acetone-2-13C,d6 is [2H]C([2H])([2H])[13C](=O)C([2H])([2H])[2H].
Is Acetone-2-13C,d6 hazardous?
Acetone-2-13C,d6 carries the following GHS hazard classifications: Flammable, Health Hazard. Signal word: Danger.
What are other names for Acetone-2-13C,d6?
Acetone-2-13C,d6 is also known as 32479-94-0, 686-129-9, Acetone-2-13C,d6, Acetone-2-13C,d6, 98 atom % D, 99 atom % 13C, RefChem:552396.
Data sourced from PubChem CID 117064417. Last updated .
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